<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-04-14 15:38:12 UTC</creation_date>
  <update_date>2026-05-14 18:13:52 UTC</update_date>
  <accession/>
  <common_name>Dexlansoprazole</common_name>
  <class>SmallMolecule</class>
  <description>Dexlansoprazole is an organic compound with the formula C16H14F3N3O2S and an average molecular weight of 369.36 g/mol. Dexlansoprazole belongs to the sulfinylbenzimidazoles, a subclass of benzimidazoles within the organic compounds. It is classified as an organoheterocyclic compound.

The compound is found in or released from one recorded source: healthcare, pharmaceuticals &amp; veterinary products, specifically drugs for acid related disorders. Recorded routes of exposure include oral and nasogastric administration. Dexlansoprazole acts on three recorded protein targets, serving as an inhibitor of N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 (DDAH1), the Potassium-transporting ATPase subunit beta (ATP4B), and the Potassium-transporting ATPase alpha chain 1 (ATP4A).</description>
  <categories/>
  <types/>
  <synonyms/>
  <chemical_formula>C16H14F3N3O2S</chemical_formula>
  <average_molecular_weight>369.36</average_molecular_weight>
  <monisotopic_moleculate_weight>369.075882366</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>138530-94-6</cas_registry_number>
  <smiles>CC1=C(OCC(F)(F)F)C=CN=C1C[S@@](=O)C1=NC2=CC=CC=C2N1</smiles>
  <inchi>InChI=1S/C16H14F3N3O2S/c1-10-13(20-7-6-14(10)24-9-16(17,18)19)8-25(23)15-21-11-4-2-3-5-12(11)22-15/h2-7H,8-9H2,1H3,(H,21,22)/t25-/m1/s1</inchi>
  <inchikey>MJIHNNLFOKEZEW-RUZDIDTESA-N</inchikey>
  <taxonomy>
    <kingdom/>
    <super_class/>
    <class/>
    <sub_class/>
    <direct_parent/>
    <alternate_parents/>
    <substituents/>
    <molecular_framework/>
    <descriptors/>
  </taxonomy>
  <status>Detected and Not Quantified</status>
  <origin/>
  <cellular_locations/>
  <biofluid_locations/>
  <tissue_locations/>
  <pathways/>
  <state/>
  <appearance/>
  <experimental_properties>
    <property>
      <kind>logp</kind>
      <value>3.03</value>
    </property>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>average_mass</kind>
      <value>369.36</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>369.075882366</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>CC1=C(OCC(F)(F)F)C=CN=C1C[S@@](=O)C1=NC2=CC=CC=C2N1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C16H14F3N3O2S</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C16H14F3N3O2S/c1-10-13(20-7-6-14(10)24-9-16(17,18)19)8-25(23)15-21-11-4-2-3-5-12(11)22-15/h2-7H,8-9H2,1H3,(H,21,22)/t25-/m1/s1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>MJIHNNLFOKEZEW-RUZDIDTESA-N</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
  <route_of_exposure/>
  <mechanism_of_toxicity/>
  <metabolism/>
  <toxicity/>
  <lethaldose/>
  <carcinogenicity/>
  <use_source/>
  <min_risk_level/>
  <health_effects>#&lt;HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f72220053c0&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id>DB05351</drugbank_id>
  <hmdb_id/>
  <pubchem_compound_id>9578005</pubchem_compound_id>
  <chembl_id/>
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  <biocyc_id/>
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  <wikipidia/>
  <general_references/>
  <targets>
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</compound>
